UCSF

ZINC38740557

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2010 32 Yes

Popular Name: N-[2-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]-1-ethyl-7-methyl-4-oxo-1,8-naphth N-[2-(4,5-dimethyl-6-oxo-1H-pyri…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.74 10.13 -67.87 1 10 -1 131 432.464 4 ↓
Mid Mid (pH 6-8) 1.28 11.6 -27.5 2 10 0 128 433.472 4 ↓

Activity (Go SEA)

Rings

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.